Journal of Communications Technology and Electronics

, volume 68 , issue 10 , pages 1169-1190

Magnetic Properties of Metal Dichalcogenide in the Frame of Heisenberg-Like Model: DFT and Monte-Carlo Methods

A I Kartsev ^{1, 2, 3}

K V Obraztsov ¹

P V Lega ^{2, 3, 4}

Hide authors affiliations Show authors affiliations: 4 affiliations

Computing Center of the Far Eastern Branch of the Russian Academy of Sciences Kim Yu Chen Str., 65, Khabarovsk, Russia |

Peoples’ Friendship University of Russia (RUDN University), Moscow, Russia |

Bauman Moscow State Technical University, Moscow, Russia |

⁴

Kotelnikov Institute of Radioengineering and Electronics, Russian Academy of Sciences, Moscow, Russia |

Publication type: Journal Article

Publication date: 2023-10-01

Pleiades Publishing

Journal of Communications Technology and Electronics

scimago Q4

wos Q4

SJR: 0.191

CiteScore: 1.1

Impact factor: 0.4

ISSN: 10642269, 15556557

DOI: 10.1134/s1064226923100054

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Electronic, Optical and Magnetic Materials

Condensed Matter Physics

Electrical and Electronic Engineering

Radiation

Abstract

We study magnetism in the 2D magnets with a $$d$$ -metal sub-lattice based on the density functional theory and Monte-Carlo simulations. The phenomena of ligand field and the macroscopic nature of $$p{\text{-}}d$$ orbitals hybridization has been discussed widely. For a magnetism in the 2D materials with a honeycomb and hexagonal $$d$$ -metal sub-latices we derive an effective Hamiltonian for a spin subsystem with and without inclusion next nearest-neighbors interaction and higher-order terms. Based on the proposed models critical temperature $${{T}_{{\text{C}}}}$$ for a wide range of compounds estimated.

Found

2 citations

Kartsev Alexey

🥼 🤝

PhD in Physics and Mathematics

34 publications, 528 citations, 61 reviews

h-index: 10

Bauman Moscow State Technical University

Computing Center of the Far Eastern Branch of the Russian Academy of Sciences

National Research University Higher School of Economics

National University of Science & Technology (MISiS)

Computational Physics

Crystallography

Density functional theory (DFT)

Electronic properties

Magnetic and structural correlations

Magnetic heterostructures

Monte Carlo simulation

Quantum Physics

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Kartsev A. I. et al. Magnetic Properties of Metal Dichalcogenide in the Frame of Heisenberg-Like Model: DFT and Monte-Carlo Methods // Journal of Communications Technology and Electronics. 2023. Vol. 68. No. 10. pp. 1169-1190.

GOST all authors (up to 50) Copy

Kartsev A. I., Obraztsov K. V., Lega P. V. Magnetic Properties of Metal Dichalcogenide in the Frame of Heisenberg-Like Model: DFT and Monte-Carlo Methods // Journal of Communications Technology and Electronics. 2023. Vol. 68. No. 10. pp. 1169-1190.

RIS |

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RIS Copy

TY - JOUR

DO - 10.1134/s1064226923100054

UR - https://doi.org/10.1134/s1064226923100054

TI - Magnetic Properties of Metal Dichalcogenide in the Frame of Heisenberg-Like Model: DFT and Monte-Carlo Methods

T2 - Journal of Communications Technology and Electronics

AU - Kartsev, A I

AU - Obraztsov, K V

AU - Lega, P V

PY - 2023

DA - 2023/10/01

PB - Pleiades Publishing

SP - 1169-1190

IS - 10

VL - 68

SN - 1064-2269

SN - 1555-6557

ER -

BibTex |

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BibTex (up to 50 authors) Copy

@article{2023_Kartsev,

author = {A I Kartsev and K V Obraztsov and P V Lega},

title = {Magnetic Properties of Metal Dichalcogenide in the Frame of Heisenberg-Like Model: DFT and Monte-Carlo Methods},

journal = {Journal of Communications Technology and Electronics},

year = {2023},

volume = {68},

publisher = {Pleiades Publishing},

month = {oct},

url = {https://doi.org/10.1134/s1064226923100054},

number = {10},

pages = {1169--1190},

doi = {10.1134/s1064226923100054}

}

MLA

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Kartsev, A. I., et al. “Magnetic Properties of Metal Dichalcogenide in the Frame of Heisenberg-Like Model: DFT and Monte-Carlo Methods.” Journal of Communications Technology and Electronics, vol. 68, no. 10, Oct. 2023, pp. 1169-1190. https://doi.org/10.1134/s1064226923100054.